3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(3-chlorobenzyl)piperazine-1-carbonyl]benzonitrile Formula: C19H18ClN3O MolecularWeight: 339.81872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H18ClN3O/c20-18-6-2-4-16(12-18)14-22-7-9-23(10-8-22)19(24)17-5-1-3-15(11-17)13-21/h1-6,11-12H,7-10,14H2